{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.777294 -2.8938177 -5.5636431 ] [ -7.7163192 0.0211766 13.6506707 ] [ -1.9192437 2.3070073 -0.2354305 ] [ 2.1896997 -13.342802 -6.0892254 ] [ 10.344301 2.466957 6.1001583 ] [ 2.8788562 11.4414788 -7.86253 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.256245378288116e-09 -4.636407063797229e-09 -8.913938901295236e-09 ] [ -1.236290622087016e-08 3.392865342803328e-11 2.187078545377957e-08 ] [ -3.074967385757689e-09 3.696233160074932e-09 -3.772012429232544e-10 ] [ 3.508285665912773e-09 -2.137752542036348e-08 -9.756014574661528e-09 ] [ 1.657339722071806e-08 3.952500829918906e-09 9.773531011439074e-09 ] [ 4.612436098285129e-09 1.833126984073884e-08 -1.259716174633862e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -5.6177696 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.000659114160968e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.8577396 2.1503821 1.6555601 ] [ 2.7123057 3.04564 4.9961069 ] [ 1.6384884 4.0294514 3.0770315 ] [ 3.7845528 1.1259108 2.5803706 ] [ 4.7531761 2.9630754 3.7145317 ] [ 3.8265164 4.6770183 2.2976572 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8577396e-10 2.1503821e-10 1.6555601e-10 ] [ 2.7123057e-10 3.04564e-10 4.996106900000001e-10 ] [ 1.6384884e-10 4.029451400000001e-10 3.0770315e-10 ] [ 3.7845528e-10 1.1259108e-10 2.5803706e-10 ] [ 4.753176100000001e-10 2.9630754e-10 3.714531700000001e-10 ] [ 3.8265164e-10 4.6770183e-10 2.2976572e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.44e-05 2.8e-06 -8e-06 ] [ -3.56e-05 -2.1e-05 3.72e-05 ] [ -6.58e-05 5.78e-05 3.24e-05 ] [ 3.66e-05 -1.63e-05 -4.4e-06 ] [ 1.8e-05 1.2e-05 -2.61e-05 ] [ 3.24e-05 -3.52e-05 -3.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.307134333952e-14 4.48609453824e-15 -1.28174129664e-14 ] [ -5.703748770048e-14 -3.36457090368e-14 5.960097029376001e-14 ] [ -1.0542322164864e-13 9.260580868224001e-14 5.191052251392001e-14 ] [ 5.863966432128e-14 -2.611547891904e-14 -7.04957713152e-15 ] [ 2.88391791744e-14 1.92261194496e-14 -4.181680980288e-14 ] [ 5.191052251392001e-14 -5.639661705216e-14 -4.982769290688e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.082112 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.416420723868713e-18 } }